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2-((benzylthio)methyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
SpectraBase Compound ID Dzf3SpBz8nB
InChI InChI=1S/C24H24N2OS/c27-23-21-22(25-20(26-23)16-28-15-17-8-2-1-3-9-17)19-11-5-4-10-18(19)14-24(21)12-6-7-13-24/h1-5,8-11H,6-7,12-16H2,(H,25,26,27)
InChIKey AAYOLRYSTQLMEP-UHFFFAOYSA-N
Mol Weight 388.53 g/mol
Molecular Formula C24H24N2OS
Exact Mass 388.160935 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DPvQ5HPXFII
Name 2-((benzylthio)methyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H24N2OS/c27-23-21-22(25-20(26-23)16-28-15-17-8-2-1-3-9-17)19-11-5-4-10-18(19)14-24(21)12-6-7-13-24/h1-5,8-11H,6-7,12-16H2,(H,25,26,27)
InChIKey AAYOLRYSTQLMEP-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_10724
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/7106267; Labnumber: MA-1130633; UZI_ID: UZI-010726
Temperature 308 °C